2-[3,4-bis(fluoranyl)phenyl]-4-methyl-3-(4-methylsulfonylphenyl)-4-propyl-cyclopent-2-en-1-one

Systemtic Name: 2-[3,4-bis(fluoranyl)phenyl]-4-methyl-3-(4-methylsulfonylphenyl)-4-propyl-cyclopent-2-en-1-one Openeye Name: 2-(3,4-difluorophenyl)-4-methyl-3-(4-methylsulfonylphenyl)-4-propyl-cyclopent-2-en-1-one CAS Name: 2-(3,4-difluorophenyl)-4-methyl-3-(4-methylsulfonylphenyl)-4-propyl-1-cyclopent-2-enone IUPAC Name: 2-(3,4-difluorophenyl)-4-methyl-3-(4-methylsulfonylphenyl)-4-propylcyclopent-2-en-1-one Traditional Name: 2-(3,4-difluorophenyl)-3-(4-mesylphenyl)-4-methyl-4-propyl-cyclopent-2-en-1-one Formula: C22H22F2O3S MolecularWeight: 404.470086

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC(=O)C(=C1C2=CC=C(C=C2)S(=O)(=O)C)C3=CC(=C(C=C3)F)F)C

Isomeric SMILES

CCCC1(CC(=O)C(=C1C2=CC=C(C=C2)S(=O)(=O)C)C3=CC(=C(C=C3)F)F)C

InChI

InChI=1S/C22H22F2O3S/c1-4-11-22(2)13-19(25)20(15-7-10-17(23)18(24)12-15)21(22)14-5-8-16(9-6-14)28(3,26)27/h5-10,12H,4,11,13H2,1-3H3